chempirical

3,5-Dibromo-4-iodotoluene

C7H5Br2ICAS 175278-10-1375.83 g/mol

Open in Covalent MOL file
BrIBr
Aryl halide

Properties

Molecular formula
C7H5Br2I
Molar mass
375.83 g/mol
Exact mass
373.7803 Da
logP
4.12Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
175278-10-1
SMILES
CC1=CC(=C(C(=C1)Br)I)Br
InChIKey
VLVXYJATBIXIPF-UHFFFAOYSA-N
InChI
InChI=1S/C7H5Br2I/c1-4-2-5(8)7(10)6(9)3-4/h2-3H,1H3

Weigh it out

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Work with 3,5-Dibromo-4-iodotoluene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Iodomesitylene4028-63-152 % similar 4-Chloro-3,5-dibromotoluene202925-05-152 % similar 2,6-Dibromo-4-methylphenol2432-14-652 % similar 1,3-Dibromo-5-fluoro-2-iodobenzene62720-29-052 % similar 2,6-Dibromo-4-methylaniline6968-24-752 % similar 3-Bromo-4-iodotoluene71838-16-952 % similar 2-Bromo-4,6-dimethylbenzenamine41825-73-450 % similar Bromo-p-xylene553-94-650 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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